Glycoside
GD001081
Name:
NoneFormula:
C36H61O10N2PSmiles:
CCCCCCCCCCCCCCCCOP(=O)(OCCOC1CC(O)C(O)C(CO)O1)Oc1ccc2[nH]cc(CCNC(C)=O)c2c1Aglycone:
CCCCCCCCCCCCCCCCOP(=O)(OCCO)Oc1ccc2[nH]cc(CCNC(C)=O)c2c1Sugarmoiety:
OCC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | 6.69 | Num_rotatable_bonds: | 27 |
| MolWt: | 712.86 | Num_heavy_atoms: | 49 |
| TPSA: | 168.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD01129
Formula: C30H51O6N2P
Smiles:
CCCCCCCCCCCCCCCCOP(=O)(OCCO)Oc1ccc2[nH]cc(CCNC(C)=O)c2c1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.7 |
| AlogP: | 7.84 | Num_rotatable_bonds: | 24 |
| MolWt: | 566.72 | Num_heavy_atoms: | 39 |
| TPSA: | 109.88 | NumAromaticRings: | 2 |
